(3S,5S)-3,5-dimethylthiomorpholin-4-ium-3,5-dicarbonitrile

Systemtic Name: (3S,5S)-3,5-dimethylthiomorpholin-4-ium-3,5-dicarbonitrile Openeye Name: (3S,5S)-3,5-dimethylthiomorpholin-4-ium-3,5-dicarbonitrile CAS Name: (3S,5S)-3,5-dimethylthiomorpholin-4-ium-3,5-dicarbonitrile IUPAC Name: (3S,5S)-3,5-dimethylthiomorpholin-4-ium-3,5-dicarbonitrile Traditional Name: (3S,5S)-3,5-dimethylthiomorpholin-4-ium-3,5-dicarbonitrile Formula: C8H12N3S+ MolecularWeight: 182.26598

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSCC([NH2+]1)(C)C#N)C#N

Isomeric SMILES

C[C@@]1(CSC[C@]([NH2+]1)(C)C#N)C#N

InChI

InChI=1S/C8H11N3S/c1-7(3-9)5-12-6-8(2,4-10)11-7/h11H,5-6H2,1-2H3/p+1/t7-,8-/m0/s1